ChemSpider 2D Image | 3-Chloro-5-(trifluoromethyl)-2(3H)-pyridinone | C6H3ClF3NO

3-Chloro-5-(trifluoromethyl)-2(3H)-pyridinone

  • Molecular FormulaC6H3ClF3NO
  • Average mass197.542 Da
  • Monoisotopic mass196.985519 Da
  • ChemSpider ID24608957

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2(3H)-Pyridinone, 3-chloro-5-(trifluoromethyl)- [ACD/Index Name]
3-Chlor-5-(trifluormethyl)-2(3H)-pyridinon [German] [ACD/IUPAC Name]
3-Chloro-5-(trifluoromethyl)-2(3H)-pyridinone [ACD/IUPAC Name]
3-Chloro-5-(trifluorométhyl)-2(3H)-pyridinone [French] [ACD/IUPAC Name]
(R)-Methyl 3-amino-3-(4-methoxyphenyl)propanoate
2-Hydroxy-3-Chloro-5-(Trifluoromethyl)Pyridine
3-Chloro-2-hydroxy-5-(trifluoromethyl)pyridine
3-chloro-5-(trifluoromethyl)-3H-pyridin-2-one
3-Chloro-5-(trifluoromethyl)pyridin-2(3H)-one
3-Chloro-5-(trifluoromethyl)pyridin-2-ol [ACD/IUPAC Name]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]
MFCD00153095 [DBID] [MDL number]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.6±0.1 g/cm3
    Boiling Point: 175.1±50.0 °C at 760 mmHg
    Vapour Pressure: 1.2±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 41.1±3.0 kJ/mol
    Flash Point: 59.7±30.1 °C
    Index of Refraction: 1.488
    Molar Refractivity: 36.3±0.5 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.03
    ACD/LogD (pH 5.5): 1.35
    ACD/BCF (pH 5.5): 6.26
    ACD/KOC (pH 5.5): 129.37
    ACD/LogD (pH 7.4): 1.35
    ACD/BCF (pH 7.4): 6.26
    ACD/KOC (pH 7.4): 129.37
    Polar Surface Area: 29 Å2
    Polarizability: 14.4±0.5 10-24cm3
    Surface Tension: 32.6±7.0 dyne/cm
    Molar Volume: 126.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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